SMILES:
CC(=O)Nc1nc(C)c(-c2ccc(S(C)(=O)=O)c(N3CCN(C)CC3)c2)s1Molecular Processing
Molecular formula
C18H24N4O3S2
Molecular weight
408.55
Exact mass
408.129
XLogP
2.23
TPSA
82.61
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
4
Heavy atoms
27
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.444
Molar refractivity
109.41
Supplementary Information
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